(1Z,3Z,5E)-cycloundeca-1,3,5,8-tetraene

C11H14 — CID 173044022

IUPAC(1Z,3Z,5E)-cycloundeca-1,3,5,8-tetraene
SMILESC1=CCC/C=C\C=C/C=C/C1
InChIInChI=1S/C11H14/c1-2-4-6-8-10-11-9-7-5-3-1/h1-6,9,11H,7-8,10H2/b2-1-,5-3+,6-4-,11-9?
InChIKeyHXXJNKDRPFIBHK-QBKLTCFVSA-N
MW146.23 g/mol
LogP3.40
Rot. Bonds

About (1Z,3Z,5E)-cycloundeca-1,3,5,8-tetraene

(1Z,3Z,5E)-cycloundeca-1,3,5,8-tetraene (PubChem CID 173044022) has the molecular formula C11H14 and a molecular weight of 146.23 g/mol. Its IUPAC name is (1Z,3Z,5E)-cycloundeca-1,3,5,8-tetraene.

Molecular Properties

Compound Name(1Z,3Z,5E)-cycloundeca-1,3,5,8-tetraene
PubChem CID173044022
Molecular FormulaC11H14
Molecular Weight146.23 g/mol
Exact Mass146.11
IUPAC Name(1Z,3Z,5E)-cycloundeca-1,3,5,8-tetraene
SMILESC1=CCC/C=C\C=C/C=C/C1
InChIInChI=1S/C11H14/c1-2-4-6-8-10-11-9-7-5-3-1/h1-6,9,11H,7-8,10H2/b2-1-,5-3+,6-4-,11-9?
InChIKeyHXXJNKDRPFIBHK-QBKLTCFVSA-N
XLogP3.40
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.23
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (1Z,3Z,5E)-cycloundeca-1,3,5,8-tetraene?
The IUPAC name of (1Z,3Z,5E)-cycloundeca-1,3,5,8-tetraene (CID 173044022) is (1Z,3Z,5E)-cycloundeca-1,3,5,8-tetraene.
What is the SMILES notation for (1Z,3Z,5E)-cycloundeca-1,3,5,8-tetraene?
The canonical SMILES for (1Z,3Z,5E)-cycloundeca-1,3,5,8-tetraene is C1=CCC/C=C\C=C/C=C/C1.
What is the InChIKey of (1Z,3Z,5E)-cycloundeca-1,3,5,8-tetraene?
The InChIKey is HXXJNKDRPFIBHK-QBKLTCFVSA-N. The full InChI is InChI=1S/C11H14/c1-2-4-6-8-10-11-9-7-5-3-1/h1-6,9,11H,7-8,10H2/b2-1-,5-3+,6-4-,11-9?.
What are the key properties of (1Z,3Z,5E)-cycloundeca-1,3,5,8-tetraene?
(1Z,3Z,5E)-cycloundeca-1,3,5,8-tetraene has a molecular weight of 146.23 g/mol, XLogP of 3.40, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,3Z,5E)-cycloundeca-1,3,5,8-tetraene is sourced from PubChem (CID 173044022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).